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	hartrees
Energy at 0K	-2662.598108
Energy at 298.15K
HF Energy	-2662.186700
Nuclear repulsion energy	124.667734

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	Σ	2300	2148	9.67
2	Σ	585	546	0.81
3	Π	376	351	1.90
3	Π	376	351	1.90

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	-1.139
N2	0.000	0.000	-2.307
Br3	0.000	0.000	0.657

	C1	N2	Br3
C1		1.1686	1.7952
N2	1.1686		2.9638
Br3	1.7952	2.9638

All results from a given calculation for BrCN (Cyanogen bromide)

using model chemistry: CCSD/6-31+G**

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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